ethyl 2-(1,2,4-triazol-4-ylcarbamothioylamino)ethanoate

Systemtic Name: ethyl 2-(1,2,4-triazol-4-ylcarbamothioylamino)ethanoate Openeye Name: ethyl 2-(1,2,4-triazol-4-ylcarbamothioylamino)acetate CAS Name: 2-[[sulfanylidene-(1,2,4-triazol-4-ylamino)methyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-(1,2,4-triazol-4-ylcarbamothioylamino)acetate Traditional Name: 2-(1,2,4-triazol-4-ylthiocarbamoylamino)acetic acid ethyl ester Formula: C7H11N5O2S MolecularWeight: 229.25954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=S)NN1C=NN=C1

Isomeric SMILES

CCOC(=O)CNC(=S)NN1C=NN=C1

InChI

InChI=1S/C7H11N5O2S/c1-2-14-6(13)3-8-7(15)11-12-4-9-10-5-12/h4-5H,2-3H2,1H3,(H2,8,11,15)